3-[[4-(diphenylmethyl)oxypiperidin-1-yl]-propyl-amino]-2-imidazo[1,2-b]pyridazin-2-yl-2-methyl-butanoic acid

Systemtic Name: 3-[[4-(diphenylmethyl)oxypiperidin-1-yl]-propyl-amino]-2-imidazo[1,2-b]pyridazin-2-yl-2-methyl-butanoic acid Openeye Name: 3-[(4-benzhydryloxy-1-piperidyl)-propyl-amino]-2-imidazo[1,2-b]pyridazin-2-yl-2-methyl-butanoic acid CAS Name: 3-[[4-(diphenylmethyl)oxy-1-piperidinyl]-propylamino]-2-(2-imidazo[1,2-b]pyridazinyl)-2-methylbutanoic acid IUPAC Name: 3-[(4-benzhydryloxypiperidin-1-yl)-propylamino]-2-imidazo[1,2-b]pyridazin-2-yl-2-methylbutanoic acid Traditional Name: 3-[(4-benzhydryloxypiperidino)-propyl-amino]-2-imidazo[1,2-b]pyridazin-2-yl-2-methyl-butyric acid Formula: C32H39N5O3 MolecularWeight: 541.68376

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Descriptors Computed from Structure

Canonical SMILES:

CCCN(C(C)C(C)(C1=CN2C(=N1)C=CC=N2)C(=O)O)N3CCC(CC3)OC(C4=CC=CC=C4)C5=CC=CC=C5

Isomeric SMILES

CCCN(C(C)C(C)(C1=CN2C(=N1)C=CC=N2)C(=O)O)N3CCC(CC3)OC(C4=CC=CC=C4)C5=CC=CC=C5

InChI

InChI=1S/C32H39N5O3/c1-4-20-37(24(2)32(3,31(38)39)28-23-36-29(34-28)16-11-19-33-36)35-21-17-27(18-22-35)40-30(25-12-7-5-8-13-25)26-14-9-6-10-15-26/h5-16,19,23-24,27,30H,4,17-18,20-22H2,1-3H3,(H,38,39)